diethyl 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanedioate

Systemtic Name: diethyl 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanedioate Openeye Name: diethyl 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanedioate CAS Name: 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanedioate Traditional Name: 2-[[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]thio]malonic acid diethyl ester Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC1=NN=C(O1)CNC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC1=NN=C(O1)CNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H19N3O6S/c1-3-24-15(22)13(16(23)25-4-2)27-17-20-19-12(26-17)10-18-14(21)11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3,(H,18,21)